2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide

C14H21NO5 — CID 112978341

IUPAC2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)COc1cccc(OC)c1OC
InChIInChI=1S/C14H21NO5/c1-17-9-5-8-15-13(16)10-20-12-7-4-6-11(18-2)14(12)19-3/h4,6-7H,5,8-10H2,1-3H3,(H,15,16)
InChIKeyFYPKESCDXOLBQD-UHFFFAOYSA-N
MW283.32 g/mol
LogP1.24
Rot. Bonds9

About 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide

2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide (PubChem CID 112978341) has the molecular formula C14H21NO5 and a molecular weight of 283.32 g/mol. Its IUPAC name is 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide
PubChem CID112978341
Molecular FormulaC14H21NO5
Molecular Weight283.32 g/mol
Exact Mass283.14
IUPAC Name2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)COc1cccc(OC)c1OC
InChIInChI=1S/C14H21NO5/c1-17-9-5-8-15-13(16)10-20-12-7-4-6-11(18-2)14(12)19-3/h4,6-7H,5,8-10H2,1-3H3,(H,15,16)
InChIKeyFYPKESCDXOLBQD-UHFFFAOYSA-N
XLogP1.24
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dimethoxyphenoxy)-N-[2-(dimethylamino)ethyl]acetamide
CID 112978344
N-[2-(2,3-dimethoxyphenoxy)ethyl]-2-phenylacetamide
CID 113101933
2-(2-acetylphenoxy)-N-(3-methoxypropyl)acetamide
CID 60626030
N-[2-(2,3-dimethoxyphenoxy)ethyl]pentanamide
CID 113101902
2-(2,3-dimethoxyphenoxy)-N'-methylacetohydrazide
CID 116820693
3-[2-(3-methoxypropylamino)-2-oxoethoxy]pyridine-2-carboxylic acid
CID 61380362
1-butyl-3-[2-(2,3-dimethoxyphenoxy)ethyl]urea
CID 112975433
2-(2,3-dimethoxyphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 112978354
2-(4-bromophenyl)-N-[2-(2,3-dimethoxyphenoxy)ethyl]acetamide
CID 113101961
2-[4-fluoro-2-(hydroxymethyl)phenoxy]-N-(3-methoxypropyl)acetamide
CID 107698563
2-[2-[(Z)-N'-hydroxycarbamimidoyl]phenoxy]-N-(3-methoxypropyl)acetamide
CID 43156183
2-(4-methoxyindol-1-yl)-N-(3-methoxypropyl)acetamide
CID 83173338

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide?
The IUPAC name of 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide (CID 112978341) is 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide.
What is the SMILES notation for 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide?
The canonical SMILES for 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide is COCCCNC(=O)COc1cccc(OC)c1OC.
What is the InChIKey of 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide?
The InChIKey is FYPKESCDXOLBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO5/c1-17-9-5-8-15-13(16)10-20-12-7-4-6-11(18-2)14(12)19-3/h4,6-7H,5,8-10H2,1-3H3,(H,15,16).
What are the key properties of 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide?
2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide has a molecular weight of 283.32 g/mol, XLogP of 1.24, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethoxyphenoxy)-N-(3-methoxypropyl)acetamide is sourced from PubChem (CID 112978341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).